input word = C00043481

Metabolite InformationStructural formula
Name E-Imperatorin acid
Formula C16H12O6
Mw 300.06338812
CAS RN 725250-33-9
C_ID C00043481 ,
InChIKey RYYKSNUIYJQIBT-RUDMXATFSA-N
InChICode InChI=1S/C16H12O6/c1-9(16(18)19)4-6-21-15-13-11(5-7-20-13)8-10-2-3-12(17)22-14(10)15/h2-5,7-8H,6H2,1H3,(H,18,19)/b9-4+
SMILES c12c(cc3c(c1OC/C=C(\C)/C(=O)O)oc(=O)cc3)cco2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus flavus Ref.
PlantaeRutaceaeCitrus maxima Ref.
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OrganismCitrus maxima
ReferenceSpath, E. et al., Ber., 1933, 66, 1137-1145 (Imperatorin, struct)